Information card for entry 4517653

Structure parameters

• Formula: C14 H28 O4 Si
• Calculated formula: C14 H28 O4 Si
• SMILES: [Si](O[C@H]1[C@@]2(O[C@@H]2C)CCO[C@@H]1CO)(C)(C(C)(C)C)C
• Title of publication: Design and Synthesis of 1,2-Deoxy-pyranose Derivatives of Spliceostatin A toward Prostate Cancer Treatment
• Authors of publication: Yoshikawa, Yusuke; Ishibashi, Airi; Takehara, Tsunayoshi; Suzuki, Takeyuki; Murai, Kenichi; Kaneda, Yasufumi; Nimura, Keisuke; Arisawa, Mitsuhiro
• Journal of publication: ACS Medicinal Chemistry Letters
• Year of publication: 2020
• a: 7.4599 ± 0.0001 Å
• b: 21.2716 ± 0.0002 Å
• c: 31.6447 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5021.51 ± 0.1 ų
• Cell temperature: 90.15 K
• Ambient diffraction temperature: 90.15 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0865
• Weighted residual factors for all reflections included in the refinement: 0.0876
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No